input word = C00044810

Metabolite InformationStructural formula
Name HTI-286
Formula C27H43N3O4
Mw 473.32535688
CAS RN 228266-40-8
C_ID C00044810 ,
InChIKey CNTMOLDWXSVYKD-UOSIQNQLNA-N
InChICode InChI=1S/C27H43N3O4/c1-17(2)20(16-18(3)25(33)34)30(10)24(32)22(26(4,5)6)29-23(31)21(28-9)27(7,8)19-14-12-11-13-15-19/h11-17,20-22,28H,1-10H3,(H,29,31)(H,33,34)/b18-16+/t20-,21-,22-/m1/s1
SMILES [C@@H](NC(=O)[C@@H](NC)C(C)(C)c1ccccc1)(C(=O)N([C@H](/C=C(\C)/C(=O)O)C(C)C)C)C(C)(C)C
Start Substs in Alk. Biosynthesis (Prediction) L-Asp L-His
Organism
Kingdom Family Species Reference
--Cymbastella sp. Ref.
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